3,5-Bis-(beta-D-glucopyranosyloxy)-7-hydroxy-2-(4-hydroxy-3-methoxyphenyl)-1-benzopyrylium chloride

CAS

132-37-6

Catalog Number

ACM132376

Category

Other Products

Molecular Weight

661.00502

Molecular Formula

C₂₈H₃₃ClO₁₆

MSDS COA Spec Sheet

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Specification

Synonyms

PEONIN CHLORIDE(SH);3,5-bis(beta-D-glucopyranosyloxy)-7-hydroxy-2-(4-hydroxy-3-methoxyphenyl)-1-benzopyrylium chloride;paeonin;PEONIDIN-3,5-DIGLUCOSIDE CHLORIDE hplc;(2S,3R,4S,5S,6R)-2-[[7-hydroxy-2-(4-hydroxy-3-methoxy-phenyl)-5-[(2S,3R,4S,5S,6R)-3,4,5-

IUPAC Name

(2S,3R,4S,5S,6R)-2-[7-hydroxy-2-(4-hydroxy-3-methoxyphenyl)-3-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxychromenylium-5-yl]oxy-6-(hydroxymethyl)oxane-3,4,5-triol chloride

Canonical SMILES

COC1=C(C=CC(=C1)C2=C(C=C3C(=CC(=CC3=[O+]2)O)OC4C(C(C(C(O4)CO)O)O)O)OC5C(C(C(C(O5)CO)O)O)O)O.[Cl-]

InChI Key

NLSMPWTZYGSAEU-CYUNEVMDSA-N

EC Number

205-060-3

Exact Mass

660.14600

H-Bond Acceptor

H-Bond Donor